NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 329 V 4.0745 8.0549 120.3990 62.6271 32.6636 175.0491 330 V 3.9434 8.1434 118.3495 58.4483 32.4934 173.3877 331 P 4.8511 0.0000 0.0000 61.7915 34.0075 174.3983 332 W 4.9949 8.0817 130.1663 56.3274 33.5849 173.4539 333 S 3.6742 6.9285 119.3986 55.2024 66.6154 171.2864 334 P 4.1366 0.0000 0.0000 61.7928 32.4736 173.4601 335 P 4.4230 0.0000 0.0000 62.7862 31.9745 175.9985 336 Q 4.6916 8.4630 123.1488 53.7678 32.3515 176.3978 337 S 4.2896 8.8848 117.0490 61.1265 63.1865 175.2635 338 N 4.8720 8.1275 117.2409 51.6183 37.5422 173.1938 339 W 4.7181 7.6493 127.1544 56.1494 32.8029 174.4710 340 N 4.2697 7.6073 124.9923 51.0133 37.8319 173.4505 341 P 4.2990 0.0000 0.0000 64.1224 31.7751 177.5738 342 W 4.7687 7.8032 119.3507 58.5131 29.3918 177.1114 343 T 4.2834 7.9803 105.2626 60.4451 69.2382 174.2930 344 S 3.3275 7.3645 117.6562 58.8184 61.0506 171.6153 345 S 4.4643 5.8100 112.7384 56.5860 66.5211 175.3723 346 N 4.9986 8.8370 118.9227 53.8802 39.3576 174.4449 347 I 4.1090 8.7523 123.6791 60.5736 37.5679 174.8502 348 D 4.6204 8.6946 126.1700 55.5577 42.8904 176.9786 349 E 4.0886 7.7949 116.8053 56.8547 30.6483 176.1799 350 G 3.8715 8.6852 107.6757 43.6996 0.0000 172.5521 351 P 4.2579 0.0000 0.0000 65.9327 30.7302 178.1705 352 L 4.2231 7.8727 116.3513 55.1490 41.8463 178.4455 353 A 3.5297 7.6365 122.0900 54.3821 18.2065 178.3529 354 F 4.9260 7.5333 110.1024 56.6887 40.7203 175.5126 355 A 4.3554 7.3717 124.0811 52.5537 18.8720 177.7798 356 T 4.5655 8.5799 111.1612 59.7808 72.0826 174.3133 357 P 4.1954 0.0000 0.0000 66.0818 31.1263 178.7921 358 E 3.9825 8.0668 115.6536 59.4209 29.5293 178.8445 359 Q 4.1669 7.6564 116.2615 59.2291 29.2860 178.8062 360 I 3.9101 7.9794 120.8188 64.4283 37.1745 178.9059 361 S 4.2597 8.3438 112.5247 59.5020 62.3597 175.4745 *363 D 4.5474 8.0029 123.6323 54.2915 42.6553 177.4335 364 L 4.2111 7.7437 118.0710 56.7941 41.4202 179.2803 365 K 3.9847 7.7914 119.0856 59.6458 32.2744 178.1994 366 N 4.4924 8.1398 114.9670 56.4399 38.8063 176.5844 367 E 4.2088 8.1392 120.0149 58.7099 29.6769 178.7031 368 L 4.1005 7.5379 116.9724 55.4770 41.2286 178.1470 *370 Y 4.2693 7.9283 123.2834 58.3884 40.5832 177.6281 371 Q 4.2048 8.3028 117.8961 58.2168 28.5653 181.3312 372 L 3.9529 8.2855 119.9754 58.8103 41.6525 179.4383 373 E 4.3706 7.6296 110.4475 56.6949 29.6152 178.3227 374 Q 4.1822 7.5466 114.7356 57.9896 30.9345 176.1423 375 D 4.5381 8.2142 122.8939 54.8559 41.4135 176.9491 *376 H 4.2844 8.6766 128.4281 59.6694 27.8231 173.6898 377 D 4.4406 7.9999 121.0527 57.2225 40.5832 178.6452 378 L 3.8742 7.5703 120.8571 58.2365 42.2136 178.9783 379 Q 4.0032 7.7058 117.3984 58.9464 28.4862 178.8659 380 A 4.0472 7.7527 121.3250 54.9315 18.3534 179.8471 381 I 3.6344 7.5868 117.8966 64.6283 37.2798 178.2920 382 L 4.1135 8.0698 122.2347 58.5953 41.1592 180.4506 383 Q 4.0066 7.6750 119.2488 60.3448 28.0418 180.5213 384 E 4.3324 8.4597 121.2534 59.2070 29.5113 179.7806 385 R 3.9918 8.4782 118.4769 59.4617 30.0023 178.8820 386 E 4.0656 8.1966 116.8722 59.2355 29.4934 178.8637 387 L 4.2186 7.4539 116.7252 55.2341 42.6205 177.2959 388 L 4.3292 7.4009 119.9225 53.4919 42.2983 176.0942 389 P 4.3374 0.0000 0.0000 65.9485 31.6238 179.0497 390 V 4.1228 7.9649 117.7068 64.2101 31.4657 178.1927 391 K 3.8654 8.1529 120.5031 59.4805 31.6638 178.3633 392 K 3.5847 7.0343 118.1923 58.9147 32.1137 178.0244 393 F 4.8459 7.7752 115.2018 56.9583 39.3718 177.0206 394 E 3.7058 7.7890 121.3124 59.6912 29.2564 179.4306 395 S 4.0887 7.9177 114.2497 61.5787 63.0863 175.7840 396 E 3.9813 8.3742 121.5302 59.5666 29.1557 179.0022 397 I 3.7689 7.8892 119.4339 64.3812 37.2624 178.1944 398 L 4.0561 7.7834 119.3028 57.8727 41.2810 179.2256 399 E 3.9096 7.9947 117.4132 59.3136 29.7761 178.4389 400 A 4.1631 8.0304 120.6569 55.3284 18.1698 179.6470 401 I 3.6995 8.2308 118.8063 64.6252 36.9766 178.6120 402 S 4.2591 8.4317 112.9501 60.3422 62.3120 175.0058 403 Q 4.5606 7.6238 118.0424 54.9739 29.8976 175.0345 404 N 5.1388 7.3639 116.4411 51.3139 42.7920 174.7436 405 S 4.3485 8.7547 117.6412 60.9847 64.1523 174.4294 406 V 4.8624 7.6459 117.3496 61.0043 34.4398 175.1311 407 V 4.5213 8.5960 125.8267 61.3142 35.6082 173.5894 408 I 4.8436 8.6347 127.6949 59.7289 39.3731 174.4611 409 I 5.0563 8.7263 128.4783 59.4766 39.1144 175.3216 410 R 5.3440 8.8132 122.6149 52.7569 33.3976 174.6723 411 G 4.4957 8.2584 109.8493 45.8887 0.0000 172.0776 412 A 4.4272 7.9170 123.7032 51.7334 19.1333 177.4565 413 T 3.7871 8.3116 116.6027 65.7172 68.7897 174.7439 414 G 4.1099 8.9609 112.9908 45.5451 0.0000 174.3103 415 C 4.2205 7.9135 116.9198 61.8715 28.5810 175.1801 416 G 4.1965 8.5313 107.9007 45.5559 0.0000 175.5624 417 K 3.8728 8.5202 120.5835 59.7722 32.3091 179.5017 418 T 3.8750 7.9727 113.5310 66.9280 68.4346 175.9941 419 T 4.2100 7.7841 108.6742 63.1335 69.7957 175.6926 420 Q 4.1028 7.8519 121.0889 57.0506 29.9474 177.9147 421 V 3.2261 7.2614 118.8601 65.3689 31.5659 176.1601 422 P 4.2067 0.0000 0.0000 65.8681 31.0591 178.5828 423 Q 4.0793 7.7992 116.2397 58.8563 28.7447 178.2528 424 F 4.5682 8.4938 119.3265 60.9140 38.7979 177.8790 425 I 3.9321 7.9637 119.3472 64.1435 36.8410 178.1856 426 L 3.9967 7.9772 121.1461 58.5300 42.0306 178.8383 427 D 4.4290 8.6228 119.1144 57.4096 40.7561 178.3950 428 D 4.3621 8.3871 118.7048 57.0944 41.1436 178.2211 429 F 4.1592 8.2009 118.4850 60.1192 39.0579 177.8211 430 I 3.7574 8.2525 119.7570 64.5900 36.7699 178.1867 431 Q 4.0186 8.0641 117.7999 59.1786 28.7072 177.8657 432 N 4.7646 7.6456 111.6226 53.3508 38.7378 174.5708 433 D 4.4964 8.1663 115.3916 56.1194 38.9830 174.7438 434 R 4.6613 8.4650 114.5548 55.7598 31.3620 177.6657 435 A 4.3071 8.3888 122.8087 55.2394 18.4009 179.5770 436 A 4.1368 7.7124 118.1364 55.0283 18.5193 177.9905 437 E 4.4711 8.6639 114.5324 56.5710 29.6867 175.5735 438 C 4.4879 7.7742 119.8930 57.6602 34.6829 172.4373 439 N 5.6066 8.9410 122.5012 51.7255 43.2640 173.5204 440 I 5.1305 9.0276 122.9912 59.5768 40.8943 174.6494 441 V 4.5830 8.8356 127.2256 60.1100 33.9611 175.1180 442 V 4.8531 7.8970 122.7260 61.3266 34.4463 174.2061 443 T 5.1133 8.8579 118.1949 60.7142 70.9154 173.6250 444 Q 4.7856 8.8573 121.3857 53.4952 32.9202 174.7055 445 P 4.1891 0.0000 0.0000 64.5985 32.1762 176.9593 446 R 4.6752 7.4799 117.4335 53.2879 35.7451 175.3824 447 R 3.7869 8.6185 121.1592 59.9575 30.0300 178.4813 448 I 3.5863 7.7876 118.7275 64.8397 37.0488 178.2049 449 S 3.9745 7.9715 114.5300 61.5409 62.6551 176.1930 450 A 3.9687 7.8229 123.4571 55.3855 18.0341 179.9194 451 V 2.9286 7.3919 116.0269 65.9436 31.6595 178.4240 452 S 3.9862 8.3637 114.3202 61.4517 62.6173 176.5908 453 V 3.3748 7.8098 121.6916 65.4509 31.1745 177.9089 454 A 3.3257 7.1325 120.7110 54.7400 18.1327 179.5401 455 E 3.8692 8.0686 117.0590 59.5237 29.5497 179.2278 456 R 3.8952 8.1433 119.1177 59.7378 29.8894 178.6655 457 V 3.5790 7.9736 117.8120 65.8192 31.4190 177.7768 458 A 4.0905 8.1836 120.6422 55.1145 18.2712 179.1375 459 F 4.0925 8.9025 119.4987 61.6937 39.2697 176.8761 460 E 4.0440 8.3318 115.3862 57.6942 29.2413 177.6083 461 R 4.3886 7.0857 115.7143 54.8627 31.3502 176.1197 462 G 3.8589 7.7071 105.4398 46.3666 0.0000 172.0237 463 E 4.7113 8.4411 115.6050 55.0558 34.4179 175.1790 464 E 4.6730 8.2867 118.6532 53.9029 31.6264 174.2597 465 P 4.6032 0.0000 0.0000 64.1419 31.8259 176.3069 466 G 3.9793 8.6388 109.0597 45.3614 0.0000 174.1903 467 K 4.0845 7.4212 120.9233 56.9219 32.9312 176.8026 468 S 4.7272 7.8317 116.6280 59.5768 65.5421 174.4899 469 C 5.2805 8.0099 118.6872 58.1431 31.9347 173.2946 470 G 4.4471 8.9511 110.4475 44.6138 0.0000 170.4800 471 Y 5.8001 7.8887 116.0084 55.0991 42.0722 174.7356 472 S 4.5792 8.6547 114.3731 57.7493 65.4830 172.9913 473 V 4.5121 8.8182 120.2635 58.7100 36.1481 174.9339 474 R 3.6671 8.3086 121.2431 58.8900 29.5973 176.1703 475 F 4.5440 10.2564 124.3793 57.3489 37.2948 174.5429 476 E 4.7633 8.2004 121.2313 54.7252 32.6193 173.5751 477 S 4.7220 8.4003 119.2966 57.3898 66.2672 174.3952 478 I 4.1596 6.9129 123.7959 58.6357 37.7403 174.3249 479 L 4.1076 7.9557 126.4705 54.0838 42.9948 175.3253 480 P 4.6512 0.0000 0.0000 61.6689 32.9830 175.7173 481 R 4.2454 8.9416 116.5300 55.3346 29.9171 176.0186 482 P 4.4019 0.0000 0.0000 64.9213 31.5363 176.6629 483 H 4.8569 7.3634 113.8105 54.7015 32.4812 173.0783 484 A 4.3453 9.0380 122.5865 51.8125 15.7955 175.3982 485 S 4.9566 7.3864 115.6242 56.8503 67.9773 174.5320 486 I 5.6919 8.1705 119.9623 58.5562 41.3731 174.4088 *488 F 4.9303 8.4339 119.5126 58.4538 40.5631 174.1945 489 C 5.3046 9.0312 115.6029 57.8562 33.5207 173.4434 490 T 4.6344 8.3997 109.3849 60.9839 69.7078 175.8892 491 V 3.6787 8.4766 121.6763 65.9217 31.4115 177.9668 492 G 3.8656 8.1989 105.1913 48.1386 0.0000 175.2002 493 V 3.5938 7.3066 120.5320 65.6469 31.5229 177.9608 494 L 4.0565 7.7173 119.5553 57.8646 41.3672 178.8320 495 L 3.9083 8.5295 119.4362 57.9568 41.4572 179.1331 496 R 3.9357 8.0184 117.4363 59.7563 30.0818 177.9798 497 K 4.1724 8.1325 119.1806 59.3173 32.0479 178.8284 498 L 4.2010 7.7483 118.1964 57.3488 41.4674 178.8824 499 E 4.0974 7.7319 117.4914 59.3884 29.5115 178.6803 500 A 4.2353 7.9894 119.4489 55.1765 18.9235 176.7331 501 G 4.4063 6.5089 101.3342 43.4919 0.0000 172.9285 502 I 4.6058 7.5921 112.9719 59.4071 38.0154 176.0347 503 R 3.2726 8.1068 118.9935 59.3901 30.2062 177.2149 504 G 3.7523 8.7439 110.7858 46.4641 0.0000 172.7537 505 I 4.2828 7.3196 120.8548 59.6557 38.3848 175.8410 506 S 4.7952 8.9878 120.3058 59.9974 64.9497 173.8993 507 H 5.2009 8.1232 116.8217 53.8476 33.1022 172.4169 508 V 4.7903 8.7848 122.7142 61.0905 34.2568 174.0807 509 I 4.9201 8.8685 128.7201 59.4834 40.2502 174.5396 510 V 4.7185 8.5509 127.6551 60.6937 32.6930 174.3488 511 D 4.7123 8.3584 128.0043 52.9819 43.0989 175.2552 512 E 3.8432 8.7002 119.1560 56.7403 27.2199 177.0256 513 I 3.6045 7.8107 112.5476 64.0121 37.6548 176.9360 514 H 4.3395 8.1234 115.4466 57.9024 28.4546 175.1119 515 E 4.1371 7.6565 120.5192 55.0714 29.3376 176.4542 516 R 4.0402 8.4981 125.2772 56.3318 30.7914 175.7321 517 D 4.7361 8.3719 123.0184 51.7476 45.3773 175.6556 518 I 3.7128 8.3831 127.8785 64.8121 37.4099 178.4450 519 N 4.5626 8.2339 116.7610 56.5669 38.4373 177.5267 520 T 3.8900 8.3287 117.1973 66.7354 68.1116 176.4107 521 D 4.3873 8.3998 120.9938 57.3814 40.9167 178.5210 522 F 4.3962 8.6968 121.5719 61.4188 39.3249 176.8171 523 L 3.6901 8.3593 120.1753 58.1407 41.8066 179.0463 524 L 4.3030 7.8334 118.8739 57.5639 41.6270 179.6463 525 V 3.7272 7.3362 117.8508 65.8765 31.5163 178.3258 526 V 3.4930 7.3935 117.8079 66.0920 31.3574 178.0037 527 L 4.0406 8.3360 119.0856 57.8258 41.2557 179.5994 528 R 4.1058 8.3506 118.8266 59.3527 30.0159 178.2898 529 D 4.3717 8.0690 118.4945 57.2147 40.8113 178.8040 530 V 3.6541 7.9000 118.6892 66.1960 31.3569 178.0728 531 V 3.5713 7.7752 116.5453 66.1703 31.3092 177.7505 532 Q 4.1295 7.6948 116.6700 59.0543 28.7222 178.3801 533 A 3.9411 7.6094 120.1053 53.8991 19.4568 177.3933 534 Y 4.8437 7.6778 114.4154 54.9339 38.6227 173.7143 535 P 4.2165 0.0000 0.0000 65.7383 31.9694 177.7266 536 E 4.1765 8.0876 114.9880 57.7817 29.8260 177.1778 537 V 3.3820 7.1501 119.1442 62.8279 32.5400 175.3353 538 R 4.7093 8.2220 123.8895 54.4378 33.1117 174.6070 539 I 4.7882 8.7642 125.4358 59.3683 40.0024 174.8062 540 V 4.7469 8.4715 126.3320 61.2176 34.5272 174.6234 541 L 5.2850 8.4945 127.8389 51.9841 45.5825 174.9227 *543 S 4.5310 8.3685 112.3507 58.8201 63.2139 174.5322 544 A 4.8629 8.9787 126.8364 52.1498 19.2461 176.5090 545 T 4.6713 7.4890 104.7364 59.2229 71.6544 173.9468 546 I 3.9015 8.1535 120.2364 63.2067 38.6226 176.0453 547 D 4.7480 7.4851 120.6733 53.8357 38.8540 176.0841 548 T 4.8296 7.5642 109.0218 61.5312 70.7514 177.4354 549 S 4.5252 7.7169 119.4189 58.2853 62.5455 176.0972 *551 F 4.8734 8.1324 120.9235 58.9977 41.3302 177.3744 552 C 4.2662 8.6320 120.3462 62.6716 31.1690 175.5715 553 E 4.0208 8.6409 120.5617 59.5957 28.8245 178.6977 554 Y 3.7067 8.0836 118.1022 59.3675 39.1258 176.7646 555 F 4.0547 8.0381 118.6938 56.4827 40.7154 175.2590 556 F 4.0941 7.3561 111.6068 60.7665 37.1082 176.2168 557 N 4.2607 8.1215 114.0989 54.5346 36.6077 174.3393 558 C 4.5742 7.6123 112.7227 57.1501 31.5240 173.7673 559 P 4.4462 0.0000 0.0000 63.2331 32.2126 175.2153 560 I 4.9028 8.3152 123.1613 59.5918 39.8186 174.9256 561 I 4.5156 8.8873 127.4225 59.4886 40.0600 174.7195 562 E 4.7160 8.6242 126.2662 55.7172 30.8850 176.6434 563 V 3.5460 7.9527 121.9350 63.1553 31.5669 174.4683 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 329 V 8.05 4.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 330 V 8.14 3.94 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.04 0.00 0.00 331 P 0.00 4.85 0.00 2.07 2.19 0.00 3.94 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.81 0.00 332 W 8.08 4.99 0.00 2.80 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 333 S 6.93 3.67 0.00 3.35 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 334 P 0.00 4.14 0.00 1.96 2.15 0.00 3.11 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.87 0.00 335 P 0.00 4.42 0.00 2.07 2.13 0.00 3.58 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 336 Q 8.46 4.69 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 337 S 8.88 4.29 0.00 4.02 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 338 N 8.13 4.87 0.00 2.98 3.02 0.00 0.00 5.64 8.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 339 W 7.65 4.72 0.00 3.26 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 340 N 7.61 4.27 0.00 2.47 2.23 0.00 0.00 6.59 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 341 P 0.00 4.30 0.00 1.51 2.08 0.00 3.16 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.36 0.00 342 W 7.80 4.77 0.00 3.36 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 343 T 7.98 4.28 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 344 S 7.36 3.33 0.00 4.01 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 345 S 5.81 4.46 0.00 3.67 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 346 N 8.84 5.00 0.00 2.67 2.82 0.00 0.00 6.92 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 347 I 8.75 4.11 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.36 0.85 0.00 0.00 348 D 8.69 4.62 0.00 2.57 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 349 E 7.79 4.09 0.00 2.17 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.87 0.00 350 G 8.69 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 351 P 0.00 4.26 0.00 2.24 2.34 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 352 L 7.87 4.22 0.00 1.72 1.76 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 353 A 7.64 3.53 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 354 F 7.53 4.93 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 355 A 7.37 4.36 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 356 T 8.58 4.57 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 357 P 0.00 4.20 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0.00 0.00 0.00 450 A 7.82 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 451 V 7.39 2.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.44 0.00 0.00 452 S 8.36 3.99 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 453 V 7.81 3.37 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.88 0.00 0.00 454 A 7.13 3.33 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 455 E 8.07 3.87 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 456 R 8.14 3.90 0.00 1.86 2.03 0.00 3.24 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 457 V 7.97 3.58 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.95 0.00 0.00 458 A 8.18 4.09 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 493 V 7.31 3.59 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 494 L 7.72 4.06 0.00 1.80 1.79 0.97 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 495 L 8.53 3.91 0.00 1.89 1.79 1.11 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 496 R 8.02 3.94 0.00 2.17 2.18 0.00 3.37 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 497 K 8.13 4.17 0.00 2.07 2.02 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.68 1.56 7.81 498 L 7.75 4.20 0.00 1.84 1.74 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 499 E 7.73 4.10 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 500 A 7.99 4.24 1.36 0.00 0.00 0.00 0.00 0.00 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2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.04 0.00 0.00 526 V 7.39 3.49 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.27 0.00 0.00 527 L 8.34 4.04 0.00 1.86 1.78 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 528 R 8.35 4.11 0.00 2.00 1.99 0.00 2.84 0.00 0.00 2.91 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.78 0.00 529 D 8.07 4.37 0.00 2.97 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 V 7.90 3.65 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.03 0.00 0.00 531 V 7.78 3.57 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.93 0.00 0.00 532 Q 7.69 4.13 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.49 2.66 0.00 533 A 7.61 3.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 Y 7.68 4.84 0.00 2.75 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 535 P 0.00 4.22 0.00 2.07 2.17 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 536 E 8.09 4.18 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 537 V 7.15 3.38 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 -0.36 0.00 0.00 538 R 8.22 4.71 0.00 1.57 1.74 0.00 3.48 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 539 I 8.76 4.79 1.64 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.05 0.65 0.00 0.00 540 V 8.47 4.75 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 541 L 8.49 5.28 0.00 1.38 1.28 0.60 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 *543 S 8.37 4.53 0.00 3.90 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 A 8.98 4.86 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 T 7.49 4.67 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 546 I 8.15 3.90 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.92 0.00 0.00 547 D 7.49 4.75 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 T 7.56 4.83 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 549 S 7.72 4.53 0.00 4.03 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *551 F 8.13 4.87 0.00 3.36 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 C 8.63 4.27 0.00 3.19 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 553 E 8.64 4.02 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 554 Y 8.08 3.71 0.00 2.81 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 F 8.04 4.05 0.00 3.05 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 F 7.36 4.09 0.00 3.22 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 557 N 8.12 4.26 0.00 2.90 2.86 0.00 0.00 6.86 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 558 C 7.61 4.57 0.00 3.17 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 559 P 0.00 4.45 0.00 2.11 2.04 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 560 I 8.32 4.90 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.63 0.91 0.00 0.00 561 I 8.89 4.52 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.86 0.00 0.00 562 E 8.62 4.72 0.00 1.60 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 563 V 7.95 3.55 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.